SCHEMBL8766485

SCHEMBL8766485

CCC1CCC(c2ccccc2F)(c2ccccc2F)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 1/20 0.38
ALOX12 P18054 1/20 0.38
PSEN1 P49768 5/20 0.36
PSEN2 P49810 5/20 0.36
APH1B Q8WW43 5/20 0.36
NCSTN Q92542 5/20 0.36
APH1A Q96BI3 5/20 0.36
PSENEN Q9NZ42 5/20 0.36
HDAC4 P56524 1/20 0.36
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM1A O60341 1/20 0.35
RCOR1 Q9UKL0 1/20 0.35
HSD11B1 P28845 2/20 0.34
HSD11B2 P80365 1/20 0.34
OPRL1 P41146 3/20 0.33
OPRM1 P35372 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8766611 0.88 HDAC4 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8766881 0.85 CYP1A2 (0.38) GAAMAPTHPGDSMN1; SMN2OPRL1
SCHEMBL8766320 0.84 GRM2 (0.37) OPRL1OPRM1
SCHEMBL8767278 0.83 GRM2 (0.39) GAAMAPT
SCHEMBL8766039 0.83 GRM2 (0.39) GAAMAPT
SCHEMBL8767014 0.83 GRM2 (0.39) GAAMAPT
SCHEMBL8766307 0.81 HDAC4 (0.38) KDM4EHDAC4HSD11B1HSD11B2OPRL1
SCHEMBL8766901 0.80 OPRM1 (0.42) KDM4EALDH1A1GAAMAPTALOX12
SCHEMBL8765847 0.79 HDAC4 (0.44) KDM4EALDH1A1GAAMAPTALOX12
SCHEMBL8766761 0.76 KDM4E (0.37) KDM4EALDH1A1GAAMAPTALOX12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0601813-B1 Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORP (JP) 1997-08-13 EP disclosed
US-5501884-A Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1996-03-26 US disclosed
US-5382688-A Diamino compounds and their production method CHISSO CORPORATION (JP) 1995-01-17 US disclosed
EP-0601813-A1 Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1994-06-15 EP disclosed